canSAR1529718
FEATURES
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NAMES
    SMILES
    CCOC(=O)CSc1nc2sc3c(c2c(=O)n1-c1ccccc1)CCN(C)C3
    InChI
    InChI=1S/C20H21N3O3S2/c1-3-26-16(24)12-27-20-21-18-17(14-9-10-22(2)11-15(14)28-18)19(25)23(20)13-7-5-4-6-8-13/h4-8H,3,9-12H2,1-2H3
    MOLECULAR FORMULA
    C20H21N3O3S2
    CROSS REFERENCES
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    canSAR1529718
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight415.10
    AlogP3.09
    HBond donors0
    HBond acceptors6
    Atoms49
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1529718.